Information card for entry 2221710

Structure parameters

• Chemical name: Dibromido(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')mercury(II)
• Formula: C14 H12 Br2 Hg N2
• Calculated formula: C14 H12 Br2 Hg N2
• SMILES: [Hg]1(Br)(Br)[n]2c(C)ccc3ccc4ccc([n]1c4c23)C
• Title of publication: Dibromido(2,9-dimethyl-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')mercury(II)
• Authors of publication: Alizadeh, Robabeh; Heidari, Amene; Ahmadi, Roya; Amani, Vahid
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: m483 - m484
• a: 7.8587 ± 0.0007 Å
• b: 10.5556 ± 0.0008 Å
• c: 18.7304 ± 0.0013 Å
• α: 90°
• β: 97.517 ± 0.006°
• γ: 90°
• Cell volume: 1540.4 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0988
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.1653
• Weighted residual factors for all reflections included in the refinement: 0.1829
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes